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1-ETHYL-N,3-DIMETHYL-4-ACETAMIDO-N-(1-PHENYL-3-METHYL-1H-PYRAZOL-5-YL)-1H-PYRAZOL-5-CARBOXAMIDE;MAJOR-ISOMER
SpectraBase Compound ID JeaAhu6ZKqI
InChI InChI=1S/C20H24N6O2/c1-6-25-19(18(14(3)23-25)21-15(4)27)20(28)24(5)17-12-13(2)22-26(17)16-10-8-7-9-11-16/h7-12H,6H2,1-5H3,(H,21,27)
InChIKey DHGBWTWUACQJGN-UHFFFAOYSA-N
Mol Weight 380.45 g/mol
Molecular Formula C20H24N6O2
Exact Mass 380.196074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3MnbAiDUz2
Name 1-ETHYL-N,3-DIMETHYL-4-ACETAMIDO-N-(1-PHENYL-3-METHYL-1H-PYRAZOL-5-YL)-1H-PYRAZOL-5-CARBOXAMIDE;MINOR-ISOMER
Compound Number 6B
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H24N6O2/c1-6-25-19(18(14(3)23-25)21-15(4)27)20(28)24(5)17-12-13(2)22-26(17)16-10-8-7-9-11-16/h7-12H,6H2,1-5H3,(H,21,27)
InChIKey DHGBWTWUACQJGN-UHFFFAOYSA-N
Literature Reference O.MIGLIARA,L.LAMARTINA,M.TIMONERI,S.PLESCIA J.HETCYCL.CHEM.,32,835(1995)
Solvent Dimethyl sulfoxide-d6
Technique APT, DEPT, INEPT; C/H SHIFT CORRELATION